NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2714 8.3144 120.1355 55.5961 33.6035 174.8358 2 E 3.8168 8.3766 120.9179 54.8707 30.1055 175.0106 3 T 4.1754 8.7173 118.3203 61.1589 72.2065 175.0664 4 A 4.0220 8.5005 123.1793 55.3055 18.3109 179.9434 5 A 4.1246 7.9843 118.6753 55.2837 18.5664 179.6007 6 A 4.0228 8.0619 119.2891 55.1051 18.3747 179.8074 7 K 4.2346 8.2891 119.6720 59.0225 32.2467 178.8792 8 F 4.1252 8.3701 121.1787 61.2159 39.3890 177.0533 9 E 4.0016 8.2473 118.1131 59.4543 29.0877 179.3142 10 R 3.9032 7.8540 117.5733 59.3399 30.2267 178.0326 11 Q 4.0700 8.0096 116.5840 57.4450 29.1740 176.0341 12 H 4.6902 7.7874 113.5786 53.8228 31.3566 172.7675 13 M 5.0026 7.9889 118.5160 53.5390 34.2378 176.2270 14 D 4.7812 8.9471 122.5348 53.1132 41.3731 175.6909 15 S 4.4787 8.4037 115.5187 59.3561 63.6720 175.4584 16 S 4.4361 8.0802 114.4424 59.4398 63.5199 174.0753 17 T 4.7434 7.4967 109.9876 60.0140 71.4472 173.9859 18 S 4.2843 8.5206 117.9924 60.1030 63.5196 173.9007 19 A 3.6749 6.9283 119.7993 50.8753 21.2066 175.4808 20 A 3.4894 8.5193 124.0720 52.1767 18.5321 178.2846 21 S 4.5216 8.4944 116.8928 58.5477 64.1592 173.5084 22 S 4.5972 7.3888 115.0269 57.2736 65.3113 175.1043 23 S 4.2773 8.5652 114.5675 60.5180 63.1460 174.5812 24 N 4.7391 7.8516 117.2709 53.5365 38.9984 176.0295 25 Y 3.9661 7.9973 121.1571 61.1637 38.6919 177.6615 26 C 4.2125 8.3359 117.0420 60.0766 38.5644 175.7859 27 N 4.3482 8.2093 117.6289 56.3805 38.0600 177.0884 28 Q 3.7858 7.9136 120.7521 59.3433 29.2344 177.9915 29 M 3.6925 7.7357 119.8820 58.3860 31.8506 178.6782 30 M 4.0731 8.1376 119.2157 57.8889 31.9829 178.7514 31 K 4.0342 7.4846 120.8533 58.6556 32.3123 178.8295 32 S 4.0181 7.9555 112.7341 61.2843 62.3597 174.8258 33 R 4.2615 7.9861 116.4232 55.6451 29.8908 175.7825 34 N 4.2089 7.6681 114.2447 54.6353 35.6879 174.8583 35 L 4.4821 8.0171 116.8351 55.2221 42.7591 178.2584 36 T 5.4434 7.5080 107.7438 60.3740 69.3998 175.8052 37 K 4.0882 8.3927 124.0542 60.0457 32.3478 177.4452 38 D 4.6685 8.0154 116.1715 55.8163 41.9832 176.2619 39 R 4.0756 7.3378 112.8982 55.2853 31.7110 174.6381 40 C 4.5701 8.6497 116.4582 55.5225 39.4291 173.7770 41 K 4.1379 8.0973 127.8366 55.8219 32.4510 175.0157 42 P 4.8313 0.0000 0.0000 65.7060 32.2614 176.5139 43 V 5.1447 7.5743 116.8460 60.4142 34.3861 173.6078 44 N 4.7623 8.7024 119.3308 53.0806 42.6438 173.0617 45 T 4.8473 7.7576 118.7776 61.6375 72.6124 172.6693 46 F 4.8419 8.9332 124.2990 55.6482 42.0091 174.5900 47 V 4.5076 8.7159 123.3434 61.3784 33.3317 175.4603 48 H 5.4716 8.7369 128.0449 53.5906 26.3644 173.1407 49 E 4.9262 7.7061 118.9052 54.4601 34.6685 175.9805 50 S 4.3464 8.5964 115.0369 57.9422 64.0430 175.0505 51 L 3.9836 8.7062 123.6660 58.4048 41.8027 179.1693 52 A 4.1381 8.0232 120.1559 55.5288 18.1343 179.2585 53 D 4.3671 7.8603 115.7422 57.2072 41.1416 178.8393 54 V 3.8300 7.6438 119.1668 65.9325 31.5764 178.1606 55 Q 3.9202 8.4994 117.9419 58.7087 28.5343 178.4395 56 A 4.0589 8.0025 121.4054 54.4330 18.3644 179.6237 57 V 3.4863 7.5536 117.0104 65.8589 31.3048 176.8925 58 C 3.7812 7.5994 114.2509 58.0868 39.8611 174.1661 59 S 4.7195 7.4986 115.9250 58.2328 64.1042 174.4286 60 Q 4.2874 7.2065 120.4866 55.8674 27.8834 178.1338 61 K 4.3518 8.2259 131.9454 56.6036 32.9582 174.3890 62 N 4.4655 8.7964 127.2656 53.4981 39.1381 174.3723 63 V 4.5826 8.4601 118.2602 59.3877 36.7607 174.5936 64 A 4.3282 8.4033 125.6754 51.9856 19.1943 178.5900 65 C 4.6212 8.9005 120.3906 56.0992 41.1952 175.1134 66 K 3.8117 8.6592 120.3330 59.6596 31.5016 178.2003 67 N 4.5802 8.0093 112.9754 52.8314 37.6962 175.3327 68 G 4.0270 8.0904 108.1435 45.7665 0.0000 174.6212 69 Q 4.1335 8.1373 118.8278 56.6952 29.1701 176.8628 70 T 4.5522 8.3632 109.3328 61.5745 69.2255 174.0822 71 N 5.0713 7.9259 118.4577 53.7658 38.3443 174.5226 72 C 5.5191 7.4829 115.6464 56.6404 44.9234 172.9175 73 Y 5.2005 8.9681 118.3594 56.3914 42.0010 173.8958 74 Q 5.1891 9.0488 124.4388 54.0703 31.6553 174.8822 75 S 4.4224 8.6536 121.5325 58.5003 63.2819 174.1563 76 Y 4.5346 9.0274 121.7328 60.7472 37.8603 176.5484 77 S 5.0485 7.8441 113.4540 56.6249 65.7797 174.3087 78 T 4.3089 8.2226 111.3695 61.9917 69.8864 173.6924 79 M 5.0470 8.9078 121.7373 53.4631 37.0696 174.4849 80 S 4.8529 9.0576 116.7170 58.1952 63.6507 173.1285 81 I 5.2874 9.0178 120.1552 59.5835 41.8079 174.2348 82 T 5.0863 8.8624 118.8479 62.0746 72.1525 172.7085 83 D 5.1727 9.3757 127.1367 53.1510 43.1946 174.7946 84 C 5.5577 9.1463 120.9520 55.1947 40.5997 172.9773 85 R 5.2173 8.8074 123.1773 54.1126 33.1147 173.8849 86 E 4.1379 9.0762 128.1308 57.0605 30.2432 176.7570 87 T 4.3720 8.3782 117.4023 60.2907 70.9623 175.9386 88 G 3.6140 8.6541 109.7159 48.1181 0.0000 174.6317 89 S 4.4525 7.3680 113.0880 58.4526 63.1999 174.2548 90 S 4.1135 7.5196 116.8885 57.8187 62.7181 173.5759 91 K 4.3657 8.6179 128.3933 55.0278 34.4553 174.4103 92 Y 4.3057 8.7893 127.8247 57.8042 38.9426 174.2207 93 P 3.1743 0.0000 0.0000 62.9860 32.2831 176.8377 94 N 4.6238 7.6863 119.7212 52.1801 36.9719 173.1916 95 C 4.5572 7.9249 117.2461 56.5683 41.6798 173.1954 96 A 5.1442 8.2648 124.5888 50.4753 21.9804 174.6098 97 Y 5.2059 9.3635 117.7269 56.2327 42.8137 174.5391 98 K 4.5768 9.2922 123.4375 55.4419 34.2877 175.1181 99 T 5.0597 8.5663 123.9642 62.5992 70.2172 174.1419 100 T 4.5926 8.8917 122.9213 61.7863 71.8585 172.6092 101 Q 4.9849 8.6787 127.6047 54.7841 30.7962 174.1069 102 A 4.5793 8.6393 126.1287 51.4092 23.7592 174.5608 103 N 5.3676 8.6987 115.9746 51.8021 40.7466 174.4671 104 K 4.7971 8.7651 122.4243 54.7277 37.5440 175.6952 105 H 4.9081 8.8482 118.3682 55.7394 30.2282 174.6695 106 I 4.9371 8.5971 114.6177 59.2110 41.0151 174.3392 107 I 4.9386 8.1506 123.9960 59.7353 40.1583 175.0971 108 V 4.7629 8.6293 119.2414 59.3688 36.0451 174.3672 109 A 5.0925 8.6308 124.3863 50.9328 20.8976 175.6439 110 C 5.1426 8.7314 118.4422 55.3436 39.1653 173.2938 111 E 4.7276 8.5888 119.8796 56.3628 34.5345 175.8705 112 G 4.0901 9.8076 108.8221 45.1018 0.0000 172.0317 113 N 5.0380 8.1879 116.3812 51.1474 40.1406 172.2350 114 P 4.2510 0.0000 0.0000 62.9053 31.9493 176.1069 115 Y 4.9142 8.3559 122.9669 57.0800 38.8728 174.6488 116 V 4.4344 8.1794 119.4290 58.4011 36.7031 173.4751 117 P 4.4850 0.0000 0.0000 62.8151 31.3207 176.9084 118 V 4.4918 8.2260 114.9844 60.8594 34.0532 174.9923 119 H 4.8805 7.7967 118.8750 55.2311 33.3171 171.9390 120 F 4.6188 8.8880 128.2789 57.3222 39.4628 174.4389 121 D 4.5115 8.2744 126.8509 56.0352 41.9007 175.7473 122 A 4.5647 6.4410 117.4898 51.5620 22.5025 174.7195 123 S 5.1317 8.8437 113.2984 56.7513 65.6041 174.7484 124 V 4.1488 8.5949 116.1128 61.5601 31.9893 175.3823 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 K 8.31 4.27 0.00 1.77 1.84 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.44 7.81 2 E 8.38 3.82 0.00 2.09 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.38 0.00 3 T 8.72 4.18 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 4 A 8.50 4.02 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 A 7.98 4.12 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 8.06 4.02 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.29 4.23 0.00 1.97 2.03 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.31 7.81 8 F 8.37 4.13 0.00 3.17 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 E 8.25 4.00 0.00 2.24 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.67 0.00 10 R 7.85 3.90 0.00 1.82 2.08 0.00 3.35 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 11 Q 8.01 4.07 0.00 1.67 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.23 2.47 0.00 12 H 7.79 4.69 0.00 2.03 2.63 0.00 5.57 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.99 5.00 0.00 1.94 2.13 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 14 D 8.95 4.78 0.00 2.70 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.40 4.48 0.00 3.93 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 8.08 4.44 0.00 3.98 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 7.50 4.74 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 18 S 8.52 4.28 0.00 3.84 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 6.93 3.67 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.52 3.49 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.49 4.52 0.00 3.97 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 7.39 4.60 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 S 8.57 4.28 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 N 7.85 4.74 0.00 2.83 2.88 0.00 0.00 6.45 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 Y 8.00 3.97 0.00 2.92 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 8.34 4.21 0.00 3.17 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.21 4.35 0.00 2.90 2.91 0.00 0.00 6.77 7.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 7.91 3.79 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 29 M 7.74 3.69 0.00 0.88 1.23 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.64 0.00 30 M 8.14 4.07 0.00 1.76 1.94 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 2.46 0.00 31 K 7.48 4.03 0.00 1.96 1.88 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.28 7.81 32 S 7.96 4.02 0.00 3.83 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.99 4.26 0.00 1.98 2.06 0.00 3.68 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.88 0.00 34 N 7.67 4.21 0.00 2.90 2.91 0.00 0.00 6.85 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 8.02 4.48 0.00 1.81 1.64 0.79 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.51 5.44 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 37 K 8.39 4.09 0.00 1.78 1.93 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.51 7.81 38 D 8.02 4.67 0.00 2.69 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.34 4.08 0.00 1.84 1.82 0.00 2.93 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.63 0.00 40 C 8.65 4.57 0.00 3.10 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.10 4.14 0.00 2.12 1.80 0.00 1.77 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.41 7.81 42 P 0.00 4.83 0.00 2.20 2.33 0.00 3.78 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.00 0.00 43 V 7.57 5.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 1.00 0.00 0.00 44 N 8.70 4.76 0.00 2.66 2.33 0.00 0.00 7.03 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 T 7.76 4.85 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 46 F 8.93 4.84 0.00 2.97 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.72 4.51 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.04 0.00 0.00 48 H 8.74 5.47 0.00 3.13 3.41 0.00 5.65 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.71 4.93 0.00 1.85 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 50 S 8.60 4.35 0.00 4.02 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.71 3.98 0.00 1.83 1.75 1.03 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.02 4.14 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 7.86 4.37 0.00 2.87 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.64 3.83 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.09 0.00 0.00 55 Q 8.50 3.92 0.00 2.24 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 56 A 8.00 4.06 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 V 7.55 3.49 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.98 0.00 0.00 58 C 7.60 3.78 0.00 2.81 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 S 7.50 4.72 0.00 3.89 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 Q 7.21 4.29 0.00 1.80 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.84 0.00 0.00 0.00 0.00 0.00 1.95 2.21 0.00 61 K 8.23 4.35 0.00 2.00 1.80 0.00 1.76 0.00 0.00 1.62 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.48 7.81 62 N 8.80 4.47 0.00 2.65 2.63 0.00 0.00 7.00 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 8.46 4.58 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.83 0.00 0.00 64 A 8.40 4.33 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 C 8.90 4.62 0.00 3.07 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.66 3.81 0.00 1.79 1.89 0.00 1.75 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.55 7.81 67 N 8.01 4.58 0.00 2.82 2.91 0.00 0.00 6.29 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 8.09 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.14 4.13 0.00 2.13 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.78 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 70 T 8.36 4.55 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 71 N 7.93 5.07 0.00 3.05 3.13 0.00 0.00 5.99 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 C 7.48 5.52 0.00 2.78 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 Y 8.97 5.20 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 9.05 5.19 0.00 2.02 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.00 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 75 S 8.65 4.42 0.00 3.93 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 Y 9.03 4.53 0.00 3.03 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.84 5.05 0.00 3.78 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 8.22 4.31 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 79 M 8.91 5.05 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.49 0.00 80 S 9.06 4.85 0.00 3.93 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.02 5.29 1.89 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.74 1.07 0.00 0.00 82 T 8.86 5.09 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 83 D 9.38 5.17 0.00 2.60 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 C 9.15 5.56 0.00 2.85 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 R 8.81 5.22 0.00 1.94 1.79 0.00 3.14 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 86 E 9.08 4.14 0.00 2.02 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.03 0.00 87 T 8.38 4.37 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 88 G 8.65 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 S 7.37 4.45 0.00 3.93 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 7.52 4.11 0.00 3.74 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 8.62 4.37 0.00 1.77 1.59 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.85 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.40 7.81 92 Y 8.79 4.31 0.00 2.96 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 3.17 0.00 1.78 1.19 0.00 3.67 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 94 N 7.69 4.62 0.00 2.85 2.76 0.00 0.00 6.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 C 7.92 4.56 0.00 3.14 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 8.26 5.14 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.36 5.21 0.00 2.83 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 9.29 4.58 0.00 1.83 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.44 7.81 99 T 8.57 5.06 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 100 T 8.89 4.59 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 101 Q 8.68 4.98 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.72 0.00 0.00 0.00 0.00 0.00 2.18 2.35 0.00 102 A 8.64 4.58 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.70 5.37 0.00 2.56 2.74 0.00 0.00 6.65 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.77 4.80 0.00 1.70 1.70 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.60 7.81 105 H 8.85 4.91 0.00 3.09 3.23 0.00 5.57 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.60 4.94 1.79 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.79 1.12 0.00 0.00 107 I 8.15 4.94 1.67 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.63 0.83 0.00 0.00 108 V 8.63 4.76 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.81 0.00 0.00 109 A 8.63 5.09 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 C 8.73 5.14 0.00 1.96 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.59 4.73 0.00 1.85 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 112 G 9.81 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.19 5.04 0.00 2.63 2.71 0.00 0.00 6.89 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 P 0.00 4.25 0.00 2.08 1.99 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 115 Y 8.36 4.91 0.00 2.80 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 V 8.18 4.43 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.48 0.00 0.49 1.15 0.00 3.33 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 118 V 8.23 4.49 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.97 0.00 0.00 119 H 7.80 4.88 0.00 3.27 3.11 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.89 4.62 0.00 2.71 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.27 4.51 0.00 2.58 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 6.44 4.56 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.84 5.13 0.00 3.95 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 V 8.59 4.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.98 0.00 0.00